BDBM50093919 2-Benzylsulfanyl-1-(3-phenyl-propyl)-5-pyrimidin-5-ylmethyl-1H-pyrimidin-4-one::CHEMBL86019

SMILES: O=c1nc(SCc2ccccc2)n(CCCc2ccccc2)cc1Cc1cncnc1

InChI Key: InChIKey=GIKKVOFXYAIOCI-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50093919   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
LDL-associated phospholipase A2 (Homo sapiens (Human))	BDBM50093919 (2-Benzylsulfanyl-1-(3-phenyl-propyl)-5-pyrimidin-5...) Show SMILES O=c1nc(SCc2ccccc2)n(CCCc2ccccc2)cc1Cc1cncnc1 Show InChI InChI=1S/C25H24N4OS/c30-24-23(14-22-15-26-19-27-16-22)17-29(13-7-12-20-8-3-1-4-9-20)25(28-24)31-18-21-10-5-2-6-11-21/h1-6,8-11,15-17,19H,7,12-14,18H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of lipoprotein associated phospholipase A2 in human plasma				Bioorg Med Chem Lett 10: 2557-61 (2001) BindingDB Entry DOI: 10.7270/Q2B857C6
					More data for this Ligand-Target Pair